SMILES:
CC(C)c1cc(C=O)cc(C(C)C)c1OCCN1CCOCC1Molecular Processing
Molecular formula
C19H29NO3
Molecular weight
319.45
Exact mass
319.2147
XLogP
3.46
TPSA
38.77
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
92.76
Supplementary Information
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